BSD Ports

science/xtb 6.4.1 DragonFly

Semiempirical Extended Tight-Binding Program Package

System
DragonFly
Repository
DPorts
Maintainer
[email protected] (as in FreeBSD)
License
GPLv3
Categories
science
Package size
3422.8 KiB, 20307.4 KiB installed

Description

Semiempirical Extended Tight-Binding Program Package

xtb implements a variety of semiempirical, tight-binding, and force field methods for computational chemistry and materials science.

WWW: https://github.com/grimme-lab/xtb

In the other systems

SystemPortVersion
DragonFlyscience/xtb6.4.1
FreeBSDscience/xtb6.7.1

Install

Binary package:

pkg install xtb

From DPorts:

cd /usr/dports/science/xtb && make install clean

Dependencies

Run dependencies 2

No port depends on this one.